HRID688965

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7972

4-Methylmorpholine

C5H11NO

HCID26255

Tetrafluoroborate

BF4-

HCID130500

未命名化合物

HCID3623886

1-(tert-Butoxycarbonyl)azetidine-2-carboxylic acid

C9H15NO4

HCID22169775

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC1C(=O)NCc1ccc2c(N)nccc2c1

HCID178451539

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-76ea79baf7674eeba9b6c7017a9232d0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[B-:28]([F:29])([F:30])([F:31])[F:32].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:12](=[O:13])[OH:14])[CH2:10][CH2:11]1.[CH3:50][N:51]1[CH2:52][CH2:53][O:54][CH2:55][CH2:56]1.[NH2:15][c:16]1[n:17][cH:18][cH:19][c:20]2[cH:21][c:22]([CH2:26][NH2:27])[cH:23][cH:24][c:25]12.[O:57]=[CH:58][N:59]([CH3:60])[CH3:61].[n:33]1([O:34][C:35]([N:36]([CH3:37])[CH3:38])=[N+:39]([CH3:40])[CH3:41])[c:42]2[cH:43][cH:44][cH:45][cH:46][c:47]2[n:48][n:49]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:12](=[O:14])[NH:27][CH2:26][c:22]2[cH:21][c:20]3[cH:19][cH:18][n:17][c:16]([NH2:15])[c:25]3[cH:24][cH:23]2)[CH2:10][CH2:11]1